Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | DGAT2 | Q96PD7 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4798178 | 0.83 | CTSS (0.53) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL6685724 | 0.81 | CTSS (0.50) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL6694457 | 0.81 | CTSS (0.46) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL6688015 | 0.80 | CTSS (0.52) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL4800654 | 0.80 | CTSS (0.52) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL4801040 | 0.79 | CTSS (0.57) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL6694048 | 0.79 | CTSS (0.45) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL4800442 | 0.79 | CTSS (0.51) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL6689771 | 0.79 | CTSS (0.44) | CTSSCYP1A2CYP2C19CTSLCTSK | |
| SCHEMBL4801431 | 0.78 | CTSS (0.61) | CTSSCYP1A2CYP2C19CTSLCTSK |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |